La6SnTe5
Alexandria ALEXAlex-ID: agm034656293 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_53_spg71
La4SnTe3 LaTe
2024-10-26 04:51:00.233697
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034656293).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm034656293
data_agm034656293
_cell_length_a 10.28172
_cell_length_b 10.28172
_cell_length_c 9.18434
_cell_angle_alpha 77.16474
_cell_angle_beta 77.16474
_cell_angle_gamma 25.89485
_cell_volume 412.85453
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
La1 La 0.33689 0.33689 0.08143 1.00000
La2 La 0.66545 0.66545 0.41689 1.00000
La3 La 0.66311 0.66311 0.91857 1.00000
La4 La 0.99990 0.99990 0.75664 1.00000
La5 La 0.00010 0.00010 0.24336 1.00000
La6 La 0.33455 0.33455 0.58311 1.00000
Sn1 Sn 0.50000 0.50000 0.00000 1.00000
Te1 Te 0.83247 0.83247 0.33446 1.00000
Te2 Te 0.16753 0.16753 0.66554 1.00000
Te3 Te 0.50000 0.50000 0.50000 1.00000
Te4 Te 0.83200 0.83200 0.83341 1.00000
Te5 Te 0.16800 0.16800 0.16659 1.00000
Get direct link